| SpectraBase Compound ID | HyFGH9Wa3Ag |
|---|---|
| InChI | InChI=1S/C10H22O/c1-3-5-6-8-10(9-11)7-4-2/h10-11H,3-9H2,1-2H3 |
| InChIKey | YLQLIQIAXYRMDL-UHFFFAOYSA-N |
| Mol Weight | 158.28 g/mol |
| Molecular Formula | C10H22O |
| Exact Mass | 158.167065 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | HBVRFPGcJOE |
|---|---|
| Name | 2-Propyl-1-heptanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.167065327 u |
| Formula | C10H22O |
| InChI | InChI=1S/C10H22O/c1-3-5-6-8-10(9-11)7-4-2/h10-11H,3-9H2,1-2H3 |
| InChIKey | YLQLIQIAXYRMDL-UHFFFAOYSA-N |
| Molecular Weight | 158.285 g/mol |
| SMILES | OCC(CCCCC)CCC |
| Spectrum/Structure Validation Score (Raman) | 0.993596 |